5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-(5-chloro-2-methoxyphenyl)furan-2-carboxamide
Chemical Structure Depiction of
5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-(5-chloro-2-methoxyphenyl)furan-2-carboxamide
5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-(5-chloro-2-methoxyphenyl)furan-2-carboxamide
Compound characteristics
| Compound ID: | Y501-1044 |
| Compound Name: | 5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-(5-chloro-2-methoxyphenyl)furan-2-carboxamide |
| Molecular Weight: | 438.71 |
| Molecular Formula: | C18 H17 Br Cl N3 O3 |
| Smiles: | Cc1c(c(C)n(Cc2ccc(C(Nc3cc(ccc3OC)[Cl])=O)o2)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.8986 |
| logD: | 3.8666 |
| logSw: | -4.3867 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.385 |
| InChI Key: | MBRZDMHIRRMGRS-UHFFFAOYSA-N |